4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol
TL;DR: 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol (CAS 81016-44-6) is a chemical compound with molecular formula C14H21NO3 and molecular weight 251.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol
Also Known As: 1-(5-Hexyl-2,4-dihydroxyphenyl)ethanone oxime
| Molecular Formula | C14H21NO3 |
|---|---|
| Molecular Weight | 251.15 g/mol |
| LogP | 3.4188 |
| Topological Polar Surface Area | 73.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 251.15215 |
| Heavy Atoms | 18 |
| Complexity | 427.29245 |
Chemical Identifiers
| CAS Number | 81016-44-6 |
|---|---|
| SMILES | CCCCCCC1=CC(=C(C=C1O)O)C(=NO)C |
Product Overview
4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol (CAS 81016-44-6), with molecular formula C14H21NO3 and molecular weight 251.15 g/mol. IUPAC: 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol.
Chemical Property Profile of 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol
Property Insights of 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol
The XLogP value of 3.4188 indicates that 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol. Following Lipinski's Rule of Five, 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol?
The CAS number of 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol is 81016-44-6.
What is the molecular formula of 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol?
The molecular formula of 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol is C14H21NO3.
What is the molecular weight of 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol?
The molecular weight of 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol is 251.15 g/mol.
Where can I buy 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol?
You can request a quote for 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 4-hexyl-6-(N-hydroxy-C-methylcarbonimidoyl)benzene-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.